Geometry & MOs

Info

ID:	252003
PubChem CID:	103108404
Reduced:	ClN3O3C13H18 (1)
Stoich.:	AB3C3D13E18 (1)
Weight, g/mol:	264.183778
ΔH_f, kcal/mol:	-43.96
Dipole, Da:	8.09
IP(EA), eV:	-9.34(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-[(2-hydroxy-2-phenylpropyl)amino]-N-methylpropanamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NCC1=C(C=C(C=C1)Cl)[N+](=O)[O-]

DOS

IR

Vibrations